N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide

C17H16N2O — CID 69189039

IUPACN'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide
SMILESO=C(Cc1ccccc1)NN[C@H]1C=Cc2ccccc21
InChIInChI=1S/C17H16N2O/c20-17(12-13-6-2-1-3-7-13)19-18-16-11-10-14-8-4-5-9-15(14)16/h1-11,16,18H,12H2,(H,19,20)/t16-/m0/s1
InChIKeyQNDBQIOCMMYGEA-INIZCTEOSA-N
MW264.33 g/mol
LogP2.62
Rot. Bonds4

About N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide

N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide (PubChem CID 69189039) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide.

Molecular Properties

Compound NameN'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide
PubChem CID69189039
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC NameN'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide
SMILESO=C(Cc1ccccc1)NN[C@H]1C=Cc2ccccc21
InChIInChI=1S/C17H16N2O/c20-17(12-13-6-2-1-3-7-13)19-18-16-11-10-14-8-4-5-9-15(14)16/h1-11,16,18H,12H2,(H,19,20)/t16-/m0/s1
InChIKeyQNDBQIOCMMYGEA-INIZCTEOSA-N
XLogP2.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-[[(1S)-1H-inden-1-yl]amino]butanoic acid
CID 40800949
N'-(2-chloroacetyl)-2-phenylacetohydrazide
CID 1133001
2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N'-[2-(4-fluorophenyl)acetyl]acetohydrazide
CID 9091953
2-phenyl-N-[[(2-phenylacetyl)amino]methyl]acetamide
CID 13210427
N'-(2-phenylacetyl)piperidine-4-carbohydrazide
CID 82121690
N-cyclopropyl-2-phenylacetamide
CID 5175687
N-[(1S,4R,5S,6R)-5,6-dihydroxy-4-[(2-phenylacetyl)amino]cyclohex-2-en-1-yl]-2-phenylacetamide
CID 102505387
lithium 2-phenylacetate
CID 19205773
calcium;hydride;2-phenylacetic acid
CID 173132712
N-(2-chloro-2,3-dihydro-1H-inden-1-yl)-2-phenylacetamide
CID 114302037
N'-(1,1-dioxothiolan-3-yl)-2-phenylacetohydrazide
CID 3805798
2-(1H-inden-1-ylsulfonyl)acetic acid
CID 88639487

Frequently Asked Questions

What is the IUPAC name of N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide?
The IUPAC name of N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide (CID 69189039) is N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide.
What is the SMILES notation for N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide?
The canonical SMILES for N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide is O=C(Cc1ccccc1)NN[C@H]1C=Cc2ccccc21.
What is the InChIKey of N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide?
The InChIKey is QNDBQIOCMMYGEA-INIZCTEOSA-N. The full InChI is InChI=1S/C17H16N2O/c20-17(12-13-6-2-1-3-7-13)19-18-16-11-10-14-8-4-5-9-15(14)16/h1-11,16,18H,12H2,(H,19,20)/t16-/m0/s1.
What are the key properties of N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide?
N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide has a molecular weight of 264.33 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(1S)-1H-inden-1-yl]-2-phenylacetohydrazide is sourced from PubChem (CID 69189039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).